N-(3,4-dimethoxyphenyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4)OC

InChI

InChI=1S/C20H17N3O3S/c1-25-16-8-6-14(12-17(16)26-2)21-19(24)13-5-7-15-18(11-13)27-20(22-15)23-9-3-4-10-23/h3-12H,1-2H3,(H,21,24)